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On direct numerical simulations of turbulent reacting flows

A description of the emerging field of direct numerical simulations of turbulent, chemically reacting flows is presented. The types of direct numerical simulations, physical issues related to implementing the simulations, as well as the various numerical methods used are described. Examples are presented of recent applications of direct numerical simulations to a variety of problems, displaying both the potential of the method and also some of its limitations. Finally, our view of the potential role of direct numerical simulations in future research on turbulent, chemically reacting flows is presented.

Jou, W.-H.↗

Direct Numerical Simulation of Acoustic Noise Generation from the Nozzle Wall of a Hypersonic Wind Tunnel

The acoustic radiation from the turbulent boundary layer on the nozzle wall of a Mach 6 Ludwieg Tube is simulated using Direct Numerical Simulations (DNS), with the flow conditions falling within the operational range of the Mach 6 Hypersonic Ludwieg Tube, Braunschweig (HLB). The mean and turbulence statistics of the nozzle-wall boundary layer show good agreement with those predicted by Pate's correlation and Reynolds Averaged Navier-Stokes (RANS) computations. The rms pressure fluctuation P'(rms)/T(w) plateaus in the freestream core of the nozzle. The intensity of the freestream noise within the nozzle is approximately 20% higher than that radiated from a single at pate with a similar freestream Mach number, potentially because of the contributions to the acoustic radiation from multiple azimuthal segments of the nozzle wall.

Huang, Junji↗

Direct Numerical Simulation of Involute Channel Turbulence

A direct numerical simulation (DNS) study was performed on turbulent flow in the high flux isotope reactor involute channel geometry to develop a numerical database and determine the differences compared with a flat parallel channel. The varying channel curvature along the walls was studied for differences in mean profiles. Parameters of interest include streamwise velocity, turbulent kinetic energy (TKE), and turbulence dissipation rate, as well as Reynolds stresses and turbulence transport terms. Profile sampling was carried out at 10 locations along the span of the involute. Additional DNS studies were performed on smaller domains of comparable curvature to the involute domain: a high curvature channel (high circular), a low curvature channel (low circular), and a flat channel (flat). Here, each of these four cases was compared against each other and to other DNS studies performed on parallel flows. The results indicate that the bulk involute channel flow does not differ significantly from a flat parallel channel flow and that the curvature of the walls does not significantly alter the mean flow parameters. However, the regions of the involute channel near the side walls exhibit relatively low magnitude twin recirculation structures driven toward the side walls from the centerline of the channel, which warrants further study.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Direct numerical simulation of compressible free shear flows

Direct numerical simulations of compressible free shear layers in open domains are conducted. Compact finite-difference schemes of spectral-like accuracy are used for the simulations. Both temporally-growing and spatially-growing mixing layers are studied. The effect of intrinsic compressibility on the evolution of vortices is studied. The use of convective Mach number is validated. Details of vortex roll up and pairing are studied. Acoustic radiation from vortex roll up, pairing and shape oscillations is studied and quantified.

Lele, Sanjiva K.↗

Interactions of Tollmien-Schlichting waves and Dean vortices. Comparison of direct numerical simulation and a weakly nonlinear theory

Direct numerical simulation is used to evaluate a weakly nonlinear theory describing the interaction of Tollmien-Schlichting waves with Dean vortices in curved channel flow. The theory and the simulation agree for certain combinations of parameters, but the two approaches give conflicting results for other combinations. Some possibilities for these discrepancies are discussed.

Singer, Bart A.↗

Direct numerical simulation of compressible free shear flows

Direct numerical simulations of compressible free shear layers in open domains are conducted. Compact finite-difference schemes of spectral-like accuracy are used for the simulations. Both temporally-growing and spatially-growing mixing layers are studied. The effect of intrinsic compressibility on the evolution of vortices is studied. The use of convective Mach number is validated. Details of vortex roll up and pairing are studied. A simple explanation of the stabilizing effect of compressibility is offered. Acoustic radiation from vortex roll up, pairing and shape oscillations is studied and quantified.

Lele, Sanjiva K.↗

Direct numerical simulation of compressible free shear flows

Direct numerical simulations of compressible free shear layers in open domains are conducted. Compact finite-difference schemes of spectral-like accuracy are used for the simulations. Both temporally-growing and spatially-growing mixing layers are studied. The effect of intrinsic compressibility on the evolution of vortices is studied. The use of convective Mach number is validated. Details of vortex roll up and pairing are studied. A simple explanation of the stabilizing effect of compressibility is offered. Acoustic radiation from vortex roll up, pairing and shape oscillations is studied and quantified.

Lele, Sanjiva K.↗

Parallel spatial direct numerical simulations on the Intel iPSC/860 hypercube

The implementation and performance of a parallel spatial direct numerical simulation (PSDNS) approach on the Intel iPSC/860 hypercube is documented. The direct numerical simulation approach is used to compute spatially evolving disturbances associated with the laminar-to-turbulent transition in boundary-layer flows. The feasibility of using the PSDNS on the hypercube to perform transition studies is examined. The results indicate that the direct numerical simulation approach can effectively be parallelized on a distributed-memory parallel machine. By increasing the number of processors nearly ideal linear speedups are achieved with nonoptimized routines; slower than linear speedups are achieved with optimized (machine dependent library) routines. This slower than linear speedup results because the Fast Fourier Transform (FFT) routine dominates the computational cost and because the routine indicates less than ideal speedups. However with the machine-dependent routines the total computational cost decreases by a factor of 4 to 5 compared with standard FORTRAN routines. The computational cost increases linearly with spanwise wall-normal and streamwise grid refinements. The hypercube with 32 processors was estimated to require approximately twice the amount of Cray supercomputer single processor time to complete a comparable simulation; however it is estimated that a subgrid-scale model which reduces the required number of grid points and becomes a large-eddy simulation (PSLES) would reduce the computational cost and memory requirements by a factor of 10 over the PSDNS. This PSLES implementation would enable transition simulations on the hypercube at a reasonable computational cost.

Joslin, Ronald D.↗

Direct Numerical Simulations of Turbulent Flow over Misaligned Traveling Waves

Direct numerical simulations of turbulent flow over prescribed traveling waves in a half-channel flow setup subject to a combined streamwise and spanwise pressure gradient are performed at a friction Reynolds number of 180. The simulations undertaken in this study consider both flow-aligned (including opposing and following) and misaligned waves as we attempt to quantify the effect of wave misalignment on turbulence statistics, the pressure drag force, and the wave attenuation rate. For the simulations, we consider three characteristic wave age values corresponding to slow-, intermediate-, and fast-moving waves. Wave misalignment is taken into account by applying a spanwise pressure gradient vertical to the traveling waves, which results in a three-dimensional turbulent flow field above the moving waves. Key flow quantities such as the mean velocity, velocity variances, and momentum fluxes are found to vary with the wave parameters, confirming the findings of previous studies.

direct numerical simulation↗

Direct numerical simulations of transition in a compressible wake

Direct numerical simulations of a compressible wake are performed to determine the sensitivity of large-scale motions to initial phase lags between the most unstable two-dimensional wave and a pair of oblique waves, and to determine the effect of Mach number on the development of three-dimensional motions. The vorticity dynamics of the flow are studied, and it is determined that, depending upon the initial phase lag, the interaction of the streamwise vorticity with the spanwise vortices may result in the formation of closed vortex loops, or in the removal of streamwise vorticity from the saddle region between the spanwise vortices. Due to lower growth rates experienced at high Mach numbers, the roll-up process is delayed, and the resultant nonlinear motions are much more diffuse.

Chen, Jacqueline H.↗

Direct Numerical Simulation of a Weakly Stratified Turbulent Wake

Direct numerical simulation (DNS) is used to investigate a time-dependent turbulent wake evolving in a stably stratified background. A large initial Froude number is chosen to allow the wake to become fully turbulent and axisymmetric before stratification affects the spreading rate of the mean defect. The uncertainty introduced by the finite sample size associated with gathering statistics from a simulation of a time-dependent flow is reduced, compared to earlier simulations of this flow. The DNS reveals the buoyancy-induced changes to the turbulence structure, as well as to the mean-defect history and the terms in the mean-momentum and turbulence-kinetic-energy budgets, that characterize the various states of this flow - namely the three-dimensional (essentially unstratified), non-equilibrium (or 'wake-collapse') and quasi-two-dimensional (or 'two-component') regimes observed elsewhere for wakes embedded in both weakly and strongly stratified backgrounds. The wake-collapse regime is not accompanied by transfer (or 'reconversion') of the potential energy of the turbulence to the kinetic energy of the turbulence, implying that this is not an essential feature of stratified-wake dynamics. The dependence upon Reynolds number of the duration of the wake-collapse period is demonstrated, and the effect of the details of the initial/near-field conditions of the wake on its subsequent development is examined.

Redford, J. A.↗

Challenge Problem 1: Preliminary Results of the Direct Numerical Simulation of Transient Flows

This report presents the first direct numerical simulations (DNS) of transient mixed convection in an idealized downcomer-like channel (Challenge Problem 1, Phase II). Using the GPU-accelerated NekRS solver, we modeled a sudden decay in driving pressure, mimicking loss-of-flow events, and tracked the resulting evolution of Reynolds number, boundary-layer structure, turbulence statistics, and heat-transfer metrics. Key findings include the systematic thickening and eventual asymmetry of velocity and thermal boundary layers under buoyant deceleration; minimal “memory” lag in Reynolds shear stress and TKE profiles when sampled at matching Re, yet clear shifts of peak locations toward the cooled wall; overshoots in transient eddy-viscosity and eddy-diffusivity (and corresponding sub-unity turbulent Prandtl numbers) on the cooled side; and a pronounced transient Nusselt-number enhancement driven by wall-temperature inertia and residual eddy mixing. These effects combined to offer a temporary cooling margin above steady-state predictions during reactor LOF transients. Future work will extend this work to a more complex “Case II” geometry (90° turn + lower plenum) and generate multi-Re/Pr datasets for data-driven turbulence closures.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Direct numerical simulations of fluid flow, heat transfer and phase changes

Direct numerical simulations of fluid flow, heat transfer, and phase changes are presented. The simulations are made possible by a recently developed finite difference/front tracking method based on the one-field formulation of the governing equations where a single set of conservation equations is written for all the phases involved. The conservation equations are solved on a fixed rectangular grid, but the phase boundaries are kept sharp by tracking them explicitly by a moving grid of lower dimension. The method is discussed and applications to boiling heat transfer and the solidification of drops colliding with a wall are shown.

Phase Transformations↗

Direct numerical simulation of reacting flows

The objectives of this work are: (1) to extend the technique of direct numerical simulations to turbulent, chemically reacting flows, (2) to test the validity of the method by comparing computational results with laboratory data, and (3) to use the simulations to gain a better understanding of the effects of turbulence on chemical reactions. The effects of both the large scale structure and the smaller scale turbulence on the overall reaction rates are addressed. The relationship between infinite reaction rate and finite reaction rate chemistry is compared with some of the results of calculations with existing theories and laboratory data. The direct numerical simulation method involves the numerical solution of the detailed evolution of the complex turbulent velocity and concentration fields. Using very efficient numerical methods (e.g., pseudospectral methods), the fully nonlinear (possibly low pass filtered) equations of motion are solved and no closure assumptions or turbulence models are used. Statistical data are obtained by performing spatial, temporal, and/or ensemble averages over the computed flow fields.

Riley, J. J.↗

Scalability of Parallel Spatial Direct Numerical Simulations on Intel Hypercube and IBM SP1 and SP2

The implementation and performance of a parallel spatial direct numerical simulation (PSDNS) approach on the Intel iPSC/860 hypercube and IBM SP1 and SP2 parallel computers is documented. Spatially evolving disturbances associated with the laminar-to-turbulent transition in boundary-layer flows are computed with the PSDNS code. The feasibility of using the PSDNS to perform transition studies on these computers is examined. The results indicate that PSDNS approach can effectively be parallelized on a distributed-memory parallel machine by remapping the distributed data structure during the course of the calculation. Scalability information is provided to estimate computational costs to match the actual costs relative to changes in the number of grid points. By increasing the number of processors, slower than linear speedups are achieved with optimized (machine-dependent library) routines. This slower than linear speedup results because the computational cost is dominated by FFT routine, which yields less than ideal speedups. By using appropriate compile options and optimized library routines on the SP1, the serial code achieves 52-56 M ops on a single node of the SP1 (45 percent of theoretical peak performance). The actual performance of the PSDNS code on the SP1 is evaluated with a "real world" simulation that consists of 1.7 million grid points. One time step of this simulation is calculated on eight nodes of the SP1 in the same time as required by a Cray Y/MP supercomputer. For the same simulation, 32-nodes of the SP1 and SP2 are required to reach the performance of a Cray C-90. A 32 node SP1 (SP2) configuration is 2.9 (4.6) times faster than a Cray Y/MP for this simulation, while the hypercube is roughly 2 times slower than the Y/MP for this application. KEY WORDS: Spatial direct numerical simulations; incompressible viscous flows; spectral methods; finite differences; parallel computing.

Joslin, Ronald D.↗

The direct numerical simulations of the turbulent wakes of axisymmetric bodies

Results of direct numerical simulations of turbulence are compared with both laboratory data and self-similarity theory for the case of the turbulent wakes of towed, axisymmetric bodies. In general, the agreement of the simulation results with both the laboratory data and the self-similarity theory is good, although the comparisons are hampered by inadequate procedures for initializing the numerical simulations.

Riley, J. J.↗

Direct numerical simulations of chemically reacting turbulent mixing layers

The results of direct numerical simulations of chemically reacting, turbulent mixing layers are presented. The reaction considered is a binary, irreversible reaction with no heat release, so that only the effect of the turbulence on the chemical reaction is investigated. The simulation results are shown to be consistent with similarity theory, and are found to be in approximate agreement with laboratory data, even though there are no adjustable parameters in the method.

Riley, J. J.↗